canSAR1810076
FEATURES
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NAMES
    SMILES
    COc1ccccc1C(CNC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)N(C)C
    InChI
    InChI=1S/C23H31N3O4S/c1-25(2)21(20-9-5-6-10-22(20)30-3)17-24-23(27)18-11-13-19(14-12-18)31(28,29)26-15-7-4-8-16-26/h5-6,9-14,21H,4,7-8,15-17H2,1-3H3,(H,24,27)
    MOLECULAR FORMULA
    C23H31N3O4S
    CROSS REFERENCES
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    canSAR1810076
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight445.20
    AlogP2.90
    HBond donors1
    HBond acceptors7
    Atoms62
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1810076.